4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide

C18H11Cl3N2O — CID 66641388

IUPAC4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide
SMILESNC(=O)c1ccc(Cl)c(-c2cccc(Cl)c2Cl)c1-c1ccccn1
InChIInChI=1S/C18H11Cl3N2O/c19-12-8-7-11(18(22)24)16(14-6-1-2-9-23-14)15(12)10-4-3-5-13(20)17(10)21/h1-9H,(H2,22,24)
InChIKeyWOWDEWNWIUHZOA-UHFFFAOYSA-N
MW377.66 g/mol
LogP5.47
Rot. Bonds3

About 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide

4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide (PubChem CID 66641388) has the molecular formula C18H11Cl3N2O and a molecular weight of 377.66 g/mol. Its IUPAC name is 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide
PubChem CID66641388
Molecular FormulaC18H11Cl3N2O
Molecular Weight377.66 g/mol
Exact Mass375.99
IUPAC Name4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide
SMILESNC(=O)c1ccc(Cl)c(-c2cccc(Cl)c2Cl)c1-c1ccccn1
InChIInChI=1S/C18H11Cl3N2O/c19-12-8-7-11(18(22)24)16(14-6-1-2-9-23-14)15(12)10-4-3-5-13(20)17(10)21/h1-9H,(H2,22,24)
InChIKeyWOWDEWNWIUHZOA-UHFFFAOYSA-N
XLogP5.47
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.66
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide?
The IUPAC name of 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide (CID 66641388) is 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide.
What is the SMILES notation for 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide?
The canonical SMILES for 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide is NC(=O)c1ccc(Cl)c(-c2cccc(Cl)c2Cl)c1-c1ccccn1.
What is the InChIKey of 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide?
The InChIKey is WOWDEWNWIUHZOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11Cl3N2O/c19-12-8-7-11(18(22)24)16(14-6-1-2-9-23-14)15(12)10-4-3-5-13(20)17(10)21/h1-9H,(H2,22,24).
What are the key properties of 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide?
4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide has a molecular weight of 377.66 g/mol, XLogP of 5.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(2,3-dichlorophenyl)-2-pyridin-2-ylbenzamide is sourced from PubChem (CID 66641388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).